N-(4-acetamidophenyl)-2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-acetamidophenyl)-2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-acetamidophenyl)-2-[[(5Z)-4-(4-chlorophenyl)-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-acetamidophenyl)-2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C27H23ClN6O2S MolecularWeight: 531.02852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NNC(=C3C=NC4=CC=CC=C43)N2C5=CC=C(C=C5)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NN/C(=C/3\C=NC4=CC=CC=C43)/N2C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H23ClN6O2S/c1-16(26(36)31-20-11-9-19(10-12-20)30-17(2)35)37-27-33-32-25(34(27)21-13-7-18(28)8-14-21)23-15-29-24-6-4-3-5-22(23)24/h3-16,32H,1-2H3,(H,30,35)(H,31,36)/b25-23-